4-[(4-bromophenyl)carbamothioylamino]benzoic acid

Systemtic Name: 4-[(4-bromophenyl)carbamothioylamino]benzoic acid Openeye Name: 4-[(4-bromophenyl)carbamothioylamino]benzoic acid CAS Name: 4-[[(4-bromoanilino)-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4-[(4-bromophenyl)carbamothioylamino]benzoic acid Traditional Name: 4-[(4-bromophenyl)thiocarbamoylamino]benzoic acid Formula: C14H11BrN2O2S MolecularWeight: 351.21834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=S)NC2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=S)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C14H11BrN2O2S/c15-10-3-7-12(8-4-10)17-14(20)16-11-5-1-9(2-6-11)13(18)19/h1-8H,(H,18,19)(H2,16,17,20)